Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN2 | P17655 | 2/20 | 0.34 |
| ▸ | MMP2 | P08253 | 8/20 | 0.33 |
| ▸ | MMP7 | P09237 | 8/20 | 0.33 |
| ▸ | MMP3 | P08254 | 7/20 | 0.33 |
| ▸ | F2 | P00734 | 2/20 | 0.33 |
| ▸ | F10 | P00742 | 2/20 | 0.33 |
| ▸ | PLG | P00747 | 2/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | PROC | P04070 | 1/20 | 0.33 |
| ▸ | MMP12 | P39900 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 6/20 | 0.33 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.32 |
| ▸ | ITGA2 | P17301 | 1/20 | 0.32 |
| ▸ | CPB2 | Q96IY4 | 3/20 | 0.32 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | KRAS | P01116 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8208869 | 0.92 | F2 (0.35) | CAPN2MMP2MMP7MMP3F2 | |
| SCHEMBL8211181 | 0.92 | F2 (0.35) | CAPN2MMP2MMP7MMP3F2 | |
| SCHEMBL12943278 | 0.89 | TMPRSS2 (0.39) | CAPN2MMP2MMP7MMP3F2 | |
| SCHEMBL8201392 | 0.89 | TMPRSS2 (0.39) | CAPN2MMP2MMP7MMP3F2 | |
| SCHEMBL8209145 | 0.89 | CPB2 (0.42) | CAPN2MMP2MMP7MMP3MMP9 | |
| SCHEMBL12943111 | 0.87 | CAPN2 (0.36) | CAPN2MMP2MMP7MMP3F2 | |
| SCHEMBL8206145 | 0.85 | MMP2 (0.44) | CAPN2MMP2MMP7MMP3MMP9 | |
| SCHEMBL8213651 | 0.84 | CAPN2 (0.46) | CAPN2MMP2MMP7MMP3MMP9 | |
| SCHEMBL15869971 | 0.78 | CAPN2 (0.35) | CAPN2MMP2MMP7MMP3F2 | |
| SCHEMBL12943279 | 0.78 | MMP2 (0.44) | CAPN2MMP2MMP7MMP3MMP9 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008048121-A2 | MACROCYCLIC CYSTEINE PROTEASE INHIBITORS AND COMPOSITIONS THEREOF | LINCOLN UNIVERSITY (NZ) | 2008-04-24 | — | — | WO | disclosed |